8HUR

Crystal structure of SARS-Cov-2 main protease in complex with S217622

8HUR の概要

• エントリーDOI: 10.2210/pdb8hur/pdb
• 分子名称: 3C-like proteinase nsp5, 6-[(6-chloranyl-2-methyl-indazol-5-yl)amino]-3-[(1-methyl-1,2,4-triazol-3-yl)methyl]-1-[[2,4,5-tris(fluoranyl)phenyl]methyl]-1,3,5-triazine-2,4-dione (3 entities in total)
• 機能のキーワード: viral protein-inhibitor complex, viral protein
• 由来する生物種: Severe acute respiratory syndrome coronavirus 2 (2019-nCoV, SARS-CoV-2)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 67187.26

構造登録者

Zhou, X.L.,Zhang, J.,Li, J. (登録日: 2022-12-24, 公開日: 2023-06-21, 最終更新日: 2024-02-07)

• 主引用文献: Lin, C.,Jiang, H.,Li, W.,Zeng, P.,Zhou, X.,Zhang, J.,Li, J.; Structural basis for the inhibition of coronaviral main proteases by ensitrelvir.; Structure, 31:1016-1024.e3, 2023; PubMed: 37421945; DOI: 10.1016/j.str.2023.06.010

実験手法

X-RAY DIFFRACTION (1.64 Å)